4-[2-azanyl-4-(4-fluorophenyl)-4-methyl-2-(trifluoromethyl)pentyl]-3-chloranyl-benzenecarbonitrile

Systemtic Name: 4-[2-azanyl-4-(4-fluorophenyl)-4-methyl-2-(trifluoromethyl)pentyl]-3-chloranyl-benzenecarbonitrile Openeye Name: 4-[2-amino-4-(4-fluorophenyl)-4-methyl-2-(trifluoromethyl)pentyl]-3-chloro-benzonitrile CAS Name: 4-[2-amino-4-(4-fluorophenyl)-4-methyl-2-(trifluoromethyl)pentyl]-3-chlorobenzonitrile IUPAC Name: 4-[2-amino-4-(4-fluorophenyl)-4-methyl-2-(trifluoromethyl)pentyl]-3-chlorobenzonitrile Traditional Name: 4-[2-amino-4-(4-fluorophenyl)-4-methyl-2-(trifluoromethyl)pentyl]-3-chloro-benzonitrile Formula: C20H19ClF4N2 MolecularWeight: 398.824873

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(CC1=C(C=C(C=C1)C#N)Cl)(C(F)(F)F)N)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(CC(CC1=C(C=C(C=C1)C#N)Cl)(C(F)(F)F)N)C2=CC=C(C=C2)F

InChI

InChI=1S/C20H19ClF4N2/c1-18(2,15-5-7-16(22)8-6-15)12-19(27,20(23,24)25)10-14-4-3-13(11-26)9-17(14)21/h3-9H,10,12,27H2,1-2H3